N-(pyridin-3-ylmethyl)-4-(1,3-thiazol-2-yl)benzamide

C16H13N3OS — CID 110690313

IUPACN-(pyridin-3-ylmethyl)-4-(1,3-thiazol-2-yl)benzamide
SMILESO=C(NCc1cccnc1)c1ccc(-c2nccs2)cc1
InChIInChI=1S/C16H13N3OS/c20-15(19-11-12-2-1-7-17-10-12)13-3-5-14(6-4-13)16-18-8-9-21-16/h1-10H,11H2,(H,19,20)
InChIKeyHZWJHACEYPNWDE-UHFFFAOYSA-N
MW295.37 g/mol
LogP3.14
Rot. Bonds4

About N-(pyridin-3-ylmethyl)-4-(1,3-thiazol-2-yl)benzamide

N-(pyridin-3-ylmethyl)-4-(1,3-thiazol-2-yl)benzamide (PubChem CID 110690313) has the molecular formula C16H13N3OS and a molecular weight of 295.37 g/mol. Its IUPAC name is N-(pyridin-3-ylmethyl)-4-(1,3-thiazol-2-yl)benzamide.

Molecular Properties

Compound NameN-(pyridin-3-ylmethyl)-4-(1,3-thiazol-2-yl)benzamide
PubChem CID110690313
Molecular FormulaC16H13N3OS
Molecular Weight295.37 g/mol
Exact Mass295.08
IUPAC NameN-(pyridin-3-ylmethyl)-4-(1,3-thiazol-2-yl)benzamide
SMILESO=C(NCc1cccnc1)c1ccc(-c2nccs2)cc1
InChIInChI=1S/C16H13N3OS/c20-15(19-11-12-2-1-7-17-10-12)13-3-5-14(6-4-13)16-18-8-9-21-16/h1-10H,11H2,(H,19,20)
InChIKeyHZWJHACEYPNWDE-UHFFFAOYSA-N
XLogP3.14
TPSA54.88 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500295.37
LogP ≤ 53.14
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze N-(pyridin-3-ylmethyl)-4-(1,3-thiazol-2-yl)benzamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

4-(aminomethyl)-N-(pyridin-3-ylmethyl)benzamide
CID 28545926
N-(pyridin-3-ylmethyl)pyridine-3-carboxamide;hydrochloride
CID 110755498
N-(pyridin-3-ylmethyl)thiophene-3-carboxamide
CID 17015853
4-ethoxy-N-(pyridin-3-ylmethyl)benzamide
CID 673607
6-bromo-N-(pyridin-3-ylmethyl)pyridine-3-carboxamide
CID 66463466
4-[4-(propanoylamino)phenyl]-N-(pyridin-3-ylmethyl)benzamide
CID 153360745
N-[(6-pyridin-3-yl-3-pyridinyl)methyl]-4-(1,3-thiazol-2-yloxy)benzamide
CID 91625934
N-butyl-4-(1,3-thiazol-2-yl)benzamide
CID 110690289
4-(ethylamino)-N-(pyridin-3-ylmethyl)benzamide
CID 62184718
4-N-(4-acetamidophenyl)-1-N-(pyridin-3-ylmethyl)benzene-1,4-dicarboxamide
CID 109047706
4-phenyl-N-[[4-(pyridin-3-ylmethoxy)phenyl]methyl]benzamide
CID 46476162
4-[(2-methylimidazol-1-yl)methyl]-N-(pyridin-3-ylmethyl)benzamide
CID 43921887

Frequently Asked Questions

What is the IUPAC name of N-(pyridin-3-ylmethyl)-4-(1,3-thiazol-2-yl)benzamide?
The IUPAC name of N-(pyridin-3-ylmethyl)-4-(1,3-thiazol-2-yl)benzamide (CID 110690313) is N-(pyridin-3-ylmethyl)-4-(1,3-thiazol-2-yl)benzamide.
What is the SMILES notation for N-(pyridin-3-ylmethyl)-4-(1,3-thiazol-2-yl)benzamide?
The canonical SMILES for N-(pyridin-3-ylmethyl)-4-(1,3-thiazol-2-yl)benzamide is O=C(NCc1cccnc1)c1ccc(-c2nccs2)cc1.
What is the InChIKey of N-(pyridin-3-ylmethyl)-4-(1,3-thiazol-2-yl)benzamide?
The InChIKey is HZWJHACEYPNWDE-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H13N3OS/c20-15(19-11-12-2-1-7-17-10-12)13-3-5-14(6-4-13)16-18-8-9-21-16/h1-10H,11H2,(H,19,20).
What are the key properties of N-(pyridin-3-ylmethyl)-4-(1,3-thiazol-2-yl)benzamide?
N-(pyridin-3-ylmethyl)-4-(1,3-thiazol-2-yl)benzamide has a molecular weight of 295.37 g/mol, XLogP of 3.14, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(pyridin-3-ylmethyl)-4-(1,3-thiazol-2-yl)benzamide is sourced from PubChem (CID 110690313), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).